Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12462359 | 0.75 | CYP1A2 (0.46) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL16835777 | 0.67 | ALDH1A1 (0.85) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL3728481 | 0.67 | IDH1 (0.43) | ENPP1 | |
| SCHEMBL9704493 | 0.67 | ALDH1A1 (0.70) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL1364796 | 0.64 | ALDH1A1 (0.62) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL3422239 | 0.64 | CYP1A2 (0.47) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL20218242 | 0.63 | CYP1A2 (0.59) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL22806019 | 0.63 | CYP1A2 (0.59) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL2493976 | 0.63 | CYP1A2 (0.59) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL29759335 | 0.63 | CYP1A2 (0.59) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6774134-B2 | FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION | BRISTOL-MYERS SQUIBB COMPANY | 2004-08-10 | — | — | US | disclosed |
| US-6774134-B2 | FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION | BRISTOL-MYERS SQUIBB COMPANY | 2004-08-10 | — | — | US | disclosed |